methyl 2-[(4-methoxy-2-nitro-phenyl)sulfonyl-prop-2-enyl-amino]ethanoate

Systemtic Name: methyl 2-[(4-methoxy-2-nitro-phenyl)sulfonyl-prop-2-enyl-amino]ethanoate Openeye Name: methyl 2-[allyl-(4-methoxy-2-nitro-phenyl)sulfonyl-amino]acetate CAS Name: 2-[(4-methoxy-2-nitrophenyl)sulfonyl-prop-2-enylamino]acetic acid methyl ester IUPAC Name: methyl 2-[(4-methoxy-2-nitrophenyl)sulfonyl-prop-2-enylamino]acetate Traditional Name: 2-[allyl-(4-methoxy-2-nitro-phenyl)sulfonyl-amino]acetic acid methyl ester Formula: C13H16N2O7S MolecularWeight: 344.34034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)S(=O)(=O)N(CC=C)CC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)S(=O)(=O)N(CC=C)CC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O7S/c1-4-7-14(9-13(16)22-3)23(19,20)12-6-5-10(21-2)8-11(12)15(17)18/h4-6,8H,1,7,9H2,2-3H3